Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.52 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | FLT1 | P17948 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL19977043 | 0.91 | MAPT (0.53) | TP53RXFP1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL19976912 | 0.88 | MRGPRX1 (0.48) | TP53MRGPRX1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL19976991 | 0.87 | MRGPRX1 (0.47) | MRGPRX1SMN1; SMN2NPC1RAB9AHPGD | |
| SCHEMBL19977052 | 0.87 | MRGPRX1 (0.47) | TP53MRGPRX1SMN1; SMN2HPGDMAPT | |
| SCHEMBL19976896 | 0.84 | SMN1; SMN2 (0.47) | MRGPRX1SMN1; SMN2NPC1RAB9AHPGD | |
| SCHEMBL16993987 | 0.83 | CTSL (0.46) | TP53MRGPRX1RXFP1SMN1; SMN2NPC1 | |
| SCHEMBL19976973 | 0.82 | KMT2A (0.44) | TP53SMN1; SMN2RAB9AMAPTHTT | |
| SCHEMBL19977126 | 0.81 | MRGPRX1 (0.44) | MRGPRX1SMN1; SMN2NPC1RAB9AHPGD | |
| SCHEMBL19976988 | 0.78 | MEN1 (0.52) | MRGPRX1SMN1; SMN2NPC1RAB9AHPGD | |
| SCHEMBL19977128 | 0.78 | F2R (0.45) | MRGPRX1SMN1; SMN2NPC1HPGDMAPT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9919998-B2 | Antibacterial agents: Nα-aroyl-N-aryl-phenylalaninamides | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2018-03-20 | — | — | US | disclosed |